Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:08 UTC
Update Date2025-03-21 18:39:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124941
Frequency20.6
Structure
Chemical FormulaC9H13O5P
Molecular Mass232.0501
SMILESCc1ccc(COP(=O)(O)O)c(C)c1O
InChI KeyLNMFLDPSSMCKMW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass cresols
Direct Parent ortho cresols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • organooxygen compounds
  • m-xylenes
  • Substituents
  • monocyclic benzene moiety
  • m-xylene
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • xylene
  • organic oxide
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • o-cresol
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound